SCHEMBL11943575

SCHEMBL11943575

COc1ccc(Sc2c(N3CCN(S(=O)(=O)c4ccccc4)CC3)cnn(C)c2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.51
ALDH1A1 P00352 2/20 0.51
POLB P06746 2/20 0.51
TP53 P04637 1/20 0.51
NPC1 O15118 2/20 0.49
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
GBA1 P04062 2/20 0.48
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
HSD11B1 P28845 1/20 0.46
LMNA P02545 3/20 0.46
TSHR P16473 2/20 0.46
MCOLN3 Q8TDD5 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PKLR P30613 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11943096 0.89 ALDH1A1 (0.55) PKMALDH1A1POLBTP53GAA
SCHEMBL11943561 0.86 MTOR (0.42) PKMALDH1A1POLBGAAMAPT
SCHEMBL11943574 0.85 MAPK1 (0.57) PKMALDH1A1NPC1GAAGBA1
SCHEMBL11943097 0.83 TSHR (0.52) PKMALDH1A1POLBTP53GBA1
SCHEMBL13305045 0.80 KMT2A (0.50) PKMALDH1A1POLBTP53GAA
SCHEMBL11943093 0.79 ALDH1A1 (0.47) PKMALDH1A1POLBTP53NPC1
SCHEMBL11943016 0.79 ALDH1A1 (0.51) PKMALDH1A1POLBNPC1GAA
SCHEMBL11943019 0.79 ALDH1A1 (0.49) PKMALDH1A1POLBTP53MAPT
SCHEMBL11943054 0.78 ALDH1A1 (0.50) PKMALDH1A1POLBNPC1GAA
SCHEMBL11943092 0.78 PKM (0.49) PKMALDH1A1POLBTP53MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 US disclosed
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors MAN2A1, GYS2, MANBA PKM 241/4885ALDH1A1 2437/4885POLB 1088/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.